5-(5-chloranyl-2-methoxy-phenyl)-4-(3-nitrophenyl)pyrrolo[3,2-d]pyrimidine-7-carbonitrile

Systemtic Name: 5-(5-chloranyl-2-methoxy-phenyl)-4-(3-nitrophenyl)pyrrolo[3,2-d]pyrimidine-7-carbonitrile Openeye Name: 5-(5-chloro-2-methoxy-phenyl)-4-(3-nitrophenyl)pyrrolo[3,2-d]pyrimidine-7-carbonitrile CAS Name: 5-(5-chloro-2-methoxyphenyl)-4-(3-nitrophenyl)-7-pyrrolo[3,2-d]pyrimidinecarbonitrile IUPAC Name: 5-(5-chloro-2-methoxyphenyl)-4-(3-nitrophenyl)pyrrolo[3,2-d]pyrimidine-7-carbonitrile Traditional Name: 5-(5-chloro-2-methoxy-phenyl)-4-(3-nitrophenyl)pyrrolo[3,2-d]pyrimidine-7-carbonitrile Formula: C20H12ClN5O3 MolecularWeight: 405.79398

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)N2C=C(C3=C2C(=NC=N3)C4=CC(=CC=C4)[N+](=O)[O-])C#N

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)N2C=C(C3=C2C(=NC=N3)C4=CC(=CC=C4)[N+](=O)[O-])C#N

InChI

InChI=1S/C20H12ClN5O3/c1-29-17-6-5-14(21)8-16(17)25-10-13(9-22)19-20(25)18(23-11-24-19)12-3-2-4-15(7-12)26(27)28/h2-8,10-11H,1H3